SCHEMBL7459666

SCHEMBL7459666

c1ccc(-c2cncc(OCC3CCNC3)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 3/20 0.67
CHRNA4 P43681 2/20 0.67
SLC6A2 P23975 4/20 0.60
SLC6A4 P31645 4/20 0.60
SLC6A3 Q01959 1/20 0.60
EP300 Q09472 1/20 0.56
CHRNA3 P32297 2/20 0.54
CHRNB3 Q05901 2/20 0.54
CHRNB1 P11230 1/20 0.54
CHRNB4 P30926 1/20 0.54
PRKCZ Q05513 1/20 0.53
IKBKB O14920 2/20 0.50
CHUK O15111 2/20 0.50
KDM1A O60341 4/20 0.49
MAOB P27338 1/20 0.49
KCNH2 Q12809 3/20 0.49
HTR3A P46098 1/20 0.49
RCOR1 Q9UKL0 1/20 0.47
CHRNA6 Q15825 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7518210 0.85 CHRNB2 (0.50) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL14941047 0.80 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA3
SCHEMBL6587381 0.80 CHRNB2 (1.00) CHRNB2CHRNA4CHRNA3
Hydrochloric Acid SCHEMBL6585349 0.79 CHRNB2 (0.97) CHRNB2CHRNA4
Hydrochloric Acid SCHEMBL6584096 0.79 CHRNB2 (0.97) CHRNB2CHRNA4
SCHEMBL27972144 0.79 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3EP300KCNH2
SCHEMBL35429 0.79 SLC6A2 (0.69) SLC6A2SLC6A4SLC6A3EP300KCNH2
SCHEMBL7468564 0.79 KDM1A (0.53) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL7457181 0.79 KDM1A (0.53) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3
SCHEMBL7466333 0.79 SLC6A2 (0.51) CHRNB2CHRNA4SLC6A2SLC6A4SLC6A3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission LIN NAN-HORNG (US) 2002-10-17 US claimed
EP-1212319-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION Abbott Laboratories (US) 2002-06-12 EP claimed
WO-2001019817-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LABORATORIES (US) 2001-03-22 WO claimed
US-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission LIN NAN-HORNG (US) 2002-10-17 US disclosed
EP-1212319-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION Abbott Laboratories (US) 2002-06-12 EP disclosed
WO-2001019817-A2 3-PYRROLIDINYLOXY-3'-PYRIDYL ETHER COMPOUNDS USEFUL FOR CONTROLLING CHEMICAL SYNAPTIC TRANSMISSION ABBOTT LABORATORIES (US) 2001-03-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020151712-A1 3-pyrrolidinyloxy-3'-pyridyl ether compounds useful for controlling chemical synaptic transmission GAP43, SLC18A2, GABRE CHRNB2 16/4885CHRNA4 12/4885SLC6A2 105/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.